5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione
TL;DR: 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione (CAS 301320-64-9) is a chemical compound with molecular formula C14H9ClN2O2 and molecular weight 272.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-2-(pyridin-4-ylmethyl)isoindole-1,3-dione
Also Known As: 5-chloro-2-(pyridin-4-ylmethyl)isoindole-1,3-dione, 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione, 5-chloro-2-(4-pyridylmethyl)benzo[c]azolidine-1,3-dione
| Molecular Formula | C14H9ClN2O2 |
|---|---|
| Molecular Weight | 272.04 g/mol |
| LogP | 2.5312 |
| Topological Polar Surface Area | 50.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.03525 |
| Heavy Atoms | 19 |
| Complexity | 670.4011 |
Chemical Identifiers
| CAS Number | 301320-64-9 |
|---|---|
| SMILES | C1=CC2=C(C=C1Cl)C(=O)N(C2=O)CC3=CC=NC=C3 |
Product Overview
5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione (CAS 301320-64-9), with molecular formula C14H9ClN2O2 and molecular weight 272.04 g/mol. IUPAC: 5-chloro-2-(pyridin-4-ylmethyl)isoindole-1,3-dione.
Chemical Property Profile of 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione
Property Insights of 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione
The XLogP value of 2.5312 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione. With a topological polar surface area (TPSA) of 50.27 Ų, 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione?
The CAS number of 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione is 301320-64-9.
What is the molecular formula of 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione?
The molecular formula of 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione is C14H9ClN2O2.
What is the molecular weight of 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione?
The molecular weight of 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione is 272.04 g/mol.
Where can I buy 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione?
You can request a quote for 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione?
Yes, KEHONG BIO provides custom synthesis services for 5-chloro-2-(pyridin-4-ylmethyl)-1H-isoindole-1,3(2H)-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.